
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 20581-45-7 |
| Catalog No. | 2A-4180914 |
| Chinese Name | 对异硫氰酸根合苯基α-D-葡糖苷 |
| Synonyms | A-D-glucopyranosylphenyl isothiocyanate |
| Molecular Formula | C13H15NO5S |
| Molecular Weight | 313.33 |
| Purity | 98% |
| Density | 1.53g/cm3 |
| Boiling Point | 538.9ºC at 760 mmHg |
| Melting Point | 184-186ºC |
| PubChem ID | 24897324 |
| MDL Number | MFCD00070374 |
| SMILES | OCC1OC(Oc2ccc(N=C=S)cc2)C(O)C(O)C1O |
| InChI | InChI=1S/C13H15NO6S/c15-5-9-10(16)11(17)12(18)13(20-9)19-8-3-1-7(2-4-8)14-6-21/h1-4,9-13,15-18H,5H2/t9-,10-,11+,12-,13+/m1/s1 |
| InChI Key | RWANFUZQWINQBY-LBELIVKGSA-N |
| NACRES Code | NA.25 |
| UNSPSC | 12352201 |
| Transport Info | Product name: p-isothiocyanatophenyl α-D-glucoside |
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